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5-(4-tert-butylphenyl)-1,3-dimethyl-6-propyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
SpectraBase Compound ID BMJ5sOykFIs
InChI InChI=1S/C21H27N3O2/c1-7-12-24-13-16-17(19(25)23(6)20(26)22(16)5)18(24)14-8-10-15(11-9-14)21(2,3)4/h8-11,13H,7,12H2,1-6H3
InChIKey JPVZWTDELWYNIF-UHFFFAOYSA-N
Mol Weight 353.47 g/mol
Molecular Formula C21H27N3O2
Exact Mass 353.210327 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EyhZqfoB6vS
Name 5-(4-tert-butylphenyl)-1,3-dimethyl-6-propyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H27N3O2/c1-7-12-24-13-16-17(19(25)23(6)20(26)22(16)5)18(24)14-8-10-15(11-9-14)21(2,3)4/h8-11,13H,7,12H2,1-6H3
InChIKey JPVZWTDELWYNIF-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27901
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D79558; Labnumber: SC_0129-1132; SBI_ID: SBI-027905
Temperature 306 °C